Geometry & MOs

Info

ID:	212207
PubChem CID:	81059817
Reduced:	NC5H7 (3)
Stoich.:	AB5C7 (3)
Weight, g/mol:	231.173548
ΔH_f, kcal/mol:	22.7
Dipole, Da:	5.38
IP(EA), eV:	-8.91(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(hexylamino)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1CCCCCN1C2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations